==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 06-APR-10 3AGT . COMPND 2 MOLECULE: HEMERYTHRIN-LIKE DOMAIN PROTEIN DCRH; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO VULGARIS; . AUTHOR A.ONODA,Y.OKAMOTO,H.SUGIMOTO,E.MIZOHATA,T.INOUE,Y.SHIRO,T.HA . 266 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15052.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 231 86.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 3 3 0 0 0 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 4 A D 0 0 119 0, 0.0 2,-0.5 0, 0.0 31,-0.2 0.000 360.0 360.0 360.0 -76.0 38.5 21.9 3.2 2 5 A V + 0 0 79 1,-0.1 3,-0.1 29,-0.1 26,-0.1 -0.938 360.0 177.4-111.2 124.4 35.8 24.7 3.5 3 6 A L S S+ 0 0 67 -2,-0.5 2,-0.4 1,-0.3 -1,-0.1 0.820 76.7 31.9 -87.2 -38.8 32.1 23.8 2.9 4 7 A V - 0 0 16 20,-0.2 2,-0.5 21,-0.0 -1,-0.3 -0.982 67.9-160.6-125.6 125.0 30.8 27.4 3.6 5 8 A K - 0 0 158 -2,-0.4 -3,-0.0 -3,-0.1 19,-0.0 -0.906 29.1-112.9-102.6 134.4 32.5 30.6 2.8 6 9 A W + 0 0 57 -2,-0.5 2,-0.3 15,-0.1 15,-0.0 -0.309 44.4 167.8 -58.6 143.1 31.4 33.7 4.6 7 10 A S > - 0 0 36 1,-0.0 3,-2.3 0, 0.0 4,-0.2 -0.962 52.6 -97.0-148.6 168.3 29.8 36.3 2.4 8 11 A E G > S+ 0 0 153 -2,-0.3 3,-1.5 1,-0.3 -2,-0.0 0.726 114.2 76.0 -55.2 -25.4 27.7 39.5 2.7 9 12 A D G 3 S+ 0 0 105 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.1 0.773 100.0 43.0 -58.9 -21.8 24.6 37.4 2.1 10 13 A L G < S+ 0 0 8 -3,-2.3 -1,-0.3 2,-0.0 -2,-0.2 0.441 90.0 120.2-101.9 -1.1 25.1 36.3 5.7 11 14 A A < + 0 0 9 -3,-1.5 2,-0.2 -4,-0.2 -3,-0.0 -0.295 23.9 140.9 -72.8 145.5 25.9 39.7 7.2 12 15 A N - 0 0 4 1,-0.3 -1,-0.1 112,-0.0 109,-0.1 -0.477 62.4 -12.1-148.9-141.9 23.7 41.3 10.0 13 16 A L S > S- 0 0 0 -2,-0.2 4,-2.5 1,-0.1 -1,-0.3 -0.416 71.9-113.6 -63.5 150.9 24.6 43.3 13.1 14 17 A P H > S+ 0 0 75 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.898 116.4 48.6 -58.1 -41.2 28.4 43.2 13.9 15 18 A S H > S+ 0 0 23 118,-2.5 4,-0.9 1,-0.2 3,-0.0 0.884 112.2 49.4 -66.4 -33.9 27.9 41.3 17.1 16 19 A I H >> S+ 0 0 0 -3,-0.2 4,-2.7 1,-0.2 3,-0.5 0.879 103.1 60.8 -71.6 -36.2 25.6 38.8 15.4 17 20 A D H 3X S+ 0 0 28 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.875 98.4 58.6 -57.5 -38.4 28.2 38.3 12.6 18 21 A T H 3X S+ 0 0 85 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.891 111.2 41.5 -60.3 -38.0 30.7 37.1 15.2 19 22 A Q H S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 4,-0.2 0.936 111.5 48.7 -62.8 -41.2 36.4 15.8 10.3 34 37 A A H ><5S+ 0 0 5 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.904 110.3 50.8 -63.4 -42.1 34.1 14.0 7.7 35 38 A R H 3<5S+ 0 0 160 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.859 110.7 49.3 -64.3 -33.8 36.7 14.4 5.0 36 39 A R T 3<5S- 0 0 112 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.434 110.8-127.0 -82.3 -3.9 39.3 12.9 7.3 37 40 A R T < 5 + 0 0 147 -3,-1.2 2,-1.0 -4,-0.2 -3,-0.2 0.838 58.1 150.7 57.5 36.7 36.8 10.0 8.1 38 41 A D >< + 0 0 61 -5,-2.6 4,-2.4 1,-0.2 -1,-0.2 -0.784 20.3 176.0-102.5 90.2 37.3 10.8 11.7 39 42 A M H > S+ 0 0 27 -2,-1.0 4,-2.4 2,-0.2 5,-0.2 0.850 77.1 54.5 -67.9 -35.1 34.0 9.9 13.4 40 43 A D H > S+ 0 0 116 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.926 113.1 43.9 -62.9 -44.5 35.1 10.5 17.0 41 44 A K H > S+ 0 0 63 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.909 111.0 55.6 -66.0 -40.6 36.1 14.1 16.0 42 45 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.919 109.3 46.0 -60.2 -40.4 32.9 14.4 14.0 43 46 A R H X S+ 0 0 78 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.927 113.0 50.7 -70.4 -35.9 30.7 13.6 17.0 44 47 A E H X S+ 0 0 132 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.941 113.7 43.3 -65.9 -44.5 32.8 15.9 19.2 45 48 A V H X S+ 0 0 9 -4,-3.0 4,-3.0 2,-0.2 -1,-0.2 0.896 111.6 54.4 -69.4 -40.7 32.4 18.9 16.7 46 49 A F H X S+ 0 0 1 -4,-2.6 4,-2.9 -5,-0.3 5,-0.2 0.947 109.5 48.2 -58.1 -45.5 28.7 18.2 16.1 47 50 A D H X S+ 0 0 62 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.933 113.2 47.1 -59.0 -43.0 28.1 18.4 19.9 48 51 A A H X S+ 0 0 30 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.894 111.4 51.5 -69.1 -37.8 30.0 21.6 20.2 49 52 A L H X S+ 0 0 9 -4,-3.0 4,-2.8 2,-0.2 -2,-0.2 0.932 111.6 47.2 -60.0 -49.0 28.2 23.1 17.1 50 53 A K H X S+ 0 0 16 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.920 112.0 49.7 -60.3 -45.9 24.8 22.2 18.7 51 54 A N H X S+ 0 0 74 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.934 112.7 47.0 -65.1 -38.4 25.8 23.6 22.0 52 55 A Y H X S+ 0 0 41 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.918 108.7 55.2 -68.8 -41.4 27.0 26.9 20.5 53 56 A A H X S+ 0 0 6 -4,-2.8 4,-3.2 1,-0.2 5,-0.2 0.931 105.6 52.6 -57.0 -43.1 23.9 27.2 18.3 54 57 A V H X S+ 0 0 36 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.898 111.9 45.9 -57.4 -42.1 21.8 26.9 21.5 55 58 A E H X S+ 0 0 136 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.913 112.5 49.9 -73.2 -34.8 23.8 29.8 23.0 56 59 A H H X S+ 0 0 2 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.950 111.0 49.8 -65.7 -46.4 23.6 31.9 19.8 57 60 A F H X S+ 0 0 6 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.919 110.4 51.0 -57.1 -43.4 19.8 31.4 19.7 58 61 A G H X S+ 0 0 33 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.888 107.6 52.6 -62.7 -35.6 19.7 32.4 23.4 59 62 A Y H X S+ 0 0 95 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.935 111.4 46.1 -66.8 -46.7 21.6 35.6 22.7 60 63 A E H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.927 111.5 51.8 -58.4 -47.0 19.2 36.5 19.9 61 64 A E H X S+ 0 0 42 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.848 107.4 53.0 -61.6 -32.0 16.3 35.7 22.1 62 65 A R H X S+ 0 0 157 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.920 108.9 48.8 -70.1 -38.9 17.7 38.0 24.8 63 66 A L H X S+ 0 0 15 -4,-2.1 4,-2.3 2,-0.2 6,-0.3 0.907 110.0 53.1 -61.6 -42.7 18.0 40.8 22.3 64 67 A F H <>S+ 0 0 1 -4,-2.4 5,-2.3 2,-0.2 4,-0.5 0.922 114.6 41.1 -60.5 -39.6 14.4 40.1 21.3 65 68 A A H ><5S+ 0 0 70 -4,-2.2 3,-1.3 2,-0.2 -2,-0.2 0.966 114.9 49.4 -73.3 -53.6 13.2 40.4 24.9 66 69 A D H 3<5S+ 0 0 93 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.866 120.8 37.1 -52.5 -40.8 15.4 43.4 25.8 67 70 A Y T 3<5S- 0 0 85 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.367 106.0-122.8-102.4 8.5 14.2 45.3 22.7 68 71 A A T < 5 - 0 0 74 -3,-1.3 -3,-0.2 -4,-0.5 -4,-0.1 0.839 35.7-166.2 56.4 39.5 10.6 44.1 22.7 69 72 A Y > < - 0 0 19 -5,-2.3 3,-1.9 -6,-0.3 4,-0.2 -0.376 18.2-137.5 -58.3 124.4 10.9 42.7 19.2 70 73 A P T 3 S+ 0 0 92 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.742 100.0 48.3 -62.0 -25.0 7.4 42.0 17.9 71 74 A E T 3> S+ 0 0 88 1,-0.2 4,-2.5 2,-0.1 5,-0.3 0.075 73.9 117.3-101.0 25.2 8.3 38.6 16.3 72 75 A A H <> S+ 0 0 19 -3,-1.9 4,-2.5 1,-0.2 5,-0.2 0.900 75.0 50.6 -54.2 -46.7 10.1 37.3 19.4 73 76 A T H > S+ 0 0 117 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.946 112.9 44.1 -62.6 -50.7 7.6 34.4 19.8 74 77 A R H > S+ 0 0 176 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.939 114.8 47.4 -59.6 -48.5 7.8 33.1 16.3 75 78 A H H X S+ 0 0 4 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.909 110.5 52.3 -68.3 -40.7 11.6 33.4 16.0 76 79 A K H X S+ 0 0 85 -4,-2.5 4,-2.8 -5,-0.3 -1,-0.2 0.901 109.5 50.4 -57.2 -41.4 12.1 31.6 19.3 77 80 A E H X S+ 0 0 63 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.901 107.4 53.2 -68.9 -36.7 9.8 28.7 18.2 78 81 A I H X S+ 0 0 48 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.922 111.8 46.3 -59.6 -47.5 11.8 28.4 14.9 79 82 A H H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.935 111.6 51.6 -59.3 -46.4 15.0 28.1 17.0 80 83 A R H X S+ 0 0 115 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.910 108.3 50.3 -60.3 -44.7 13.4 25.6 19.4 81 84 A R H X S+ 0 0 156 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.900 110.7 50.0 -61.5 -39.5 12.2 23.4 16.5 82 85 A F H X S+ 0 0 7 -4,-1.8 4,-3.1 -5,-0.2 -2,-0.2 0.910 107.8 52.9 -67.4 -40.9 15.7 23.4 15.0 83 86 A V H X S+ 0 0 34 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.949 110.3 48.9 -55.1 -46.5 17.3 22.4 18.3 84 87 A E H X S+ 0 0 50 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.913 112.3 48.8 -58.0 -45.5 14.9 19.5 18.5 85 88 A T H X S+ 0 0 45 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.916 109.1 51.4 -59.8 -45.1 15.8 18.6 14.9 86 89 A V H X S+ 0 0 5 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.878 107.8 53.0 -60.1 -39.9 19.6 18.8 15.6 87 90 A L H X S+ 0 0 32 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.900 109.9 49.0 -65.1 -37.2 19.1 16.5 18.7 88 91 A K H >X S+ 0 0 127 -4,-1.8 4,-0.6 -5,-0.2 3,-0.6 0.934 111.3 48.6 -66.3 -45.4 17.3 14.0 16.4 89 92 A W H >X S+ 0 0 78 -4,-2.6 3,-1.0 1,-0.2 4,-0.5 0.878 102.8 63.4 -63.2 -34.8 20.1 14.2 13.8 90 93 A E H >X S+ 0 0 47 -4,-2.3 3,-1.6 1,-0.3 4,-0.5 0.863 91.3 65.5 -58.0 -36.5 22.7 13.7 16.5 91 94 A K H X< S+ 0 0 155 -4,-1.1 3,-0.9 -3,-0.6 4,-0.4 0.848 94.6 58.6 -59.5 -32.6 21.3 10.2 17.2 92 95 A Q H > - 0 0 78 -59,-0.0 4,-2.0 -58,-0.0 3,-0.7 -0.602 44.6 -81.5-113.0-177.7 29.8 6.8 8.9 98 101 A P H 3> S+ 0 0 12 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.846 129.0 58.6 -61.6 -27.2 31.4 9.8 7.2 99 102 A E H 3> S+ 0 0 92 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.896 103.9 51.0 -67.0 -37.1 28.6 9.8 4.6 100 103 A V H <> S+ 0 0 39 -3,-0.7 4,-2.6 2,-0.2 5,-0.2 0.918 108.8 53.4 -61.6 -41.8 26.0 10.2 7.4 101 104 A V H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.932 109.2 48.2 -59.4 -43.6 28.1 13.1 8.6 102 105 A M H X S+ 0 0 49 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.913 110.3 49.6 -65.5 -41.8 28.0 14.7 5.2 103 106 A T H X S+ 0 0 78 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.939 113.3 47.8 -60.9 -44.4 24.2 14.2 4.8 104 107 A T H X S+ 0 0 14 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.930 109.2 54.2 -58.0 -47.2 23.8 15.8 8.2 105 108 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.907 104.7 53.2 -56.6 -45.1 26.1 18.6 7.3 106 109 A R H X S+ 0 0 135 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.903 110.0 48.6 -59.3 -40.2 24.1 19.4 4.2 107 110 A G H X S+ 0 0 20 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.900 111.7 49.4 -65.2 -40.9 20.9 19.7 6.4 108 111 A L H X S+ 0 0 4 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.950 113.8 45.2 -61.5 -48.3 22.7 21.9 8.9 109 112 A V H X S+ 0 0 21 -4,-2.9 4,-2.8 1,-0.2 5,-0.4 0.920 112.4 51.0 -64.5 -43.8 24.0 24.2 6.2 110 113 A D H X S+ 0 0 113 -4,-2.4 4,-1.8 -5,-0.3 5,-0.2 0.933 114.4 43.5 -62.8 -42.9 20.7 24.4 4.4 111 114 A W H X S+ 0 0 57 -4,-2.3 4,-3.1 -5,-0.2 -2,-0.2 0.954 116.3 46.8 -65.2 -49.0 18.8 25.3 7.5 112 115 A L H X S+ 0 0 13 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.917 112.1 47.4 -64.8 -45.2 21.4 27.8 8.8 113 116 A V H X S+ 0 0 48 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.942 116.6 44.8 -64.7 -44.3 21.9 29.7 5.5 114 117 A N H X>S+ 0 0 91 -4,-1.8 4,-2.7 -5,-0.4 5,-0.5 0.924 113.9 50.0 -63.9 -43.4 18.1 30.0 5.0 115 118 A H H X>S+ 0 0 4 -4,-3.1 5,-2.8 -5,-0.2 4,-2.1 0.929 112.7 45.6 -61.9 -44.3 17.5 31.0 8.6 116 119 A I H <>S+ 0 0 2 -4,-2.7 5,-1.2 3,-0.2 -1,-0.2 0.930 119.6 40.5 -63.0 -48.3 20.2 33.7 8.6 117 120 A M H <5S+ 0 0 82 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.824 128.6 27.6 -75.1 -29.5 19.0 35.1 5.3 118 121 A K H <5S+ 0 0 112 -4,-2.7 4,-0.2 -5,-0.2 -3,-0.2 0.838 133.1 21.4-102.2 -40.9 15.3 34.9 5.8 119 122 A E T ><>> S+ 0 0 1 -3,-1.6 4,-2.4 -4,-0.5 -1,-0.3 0.558 91.6 86.3 -91.2 -8.8 15.3 41.7 13.1 124 127 A E H S+ 0 0 41 -4,-0.3 4,-0.6 1,-0.2 -2,-0.2 0.929 113.2 39.1 -56.0 -47.3 14.6 46.9 14.0 127 130 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.3 1,-0.2 3,-0.7 0.901 112.2 55.9 -74.8 -38.1 17.7 46.5 16.2 128 131 A R H ><5S+ 0 0 127 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.913 105.2 53.1 -57.5 -44.3 19.9 48.9 14.3 129 132 A E H 3<5S+ 0 0 143 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.717 107.1 53.6 -69.0 -16.3 17.3 51.7 14.7 130 133 A R T <<5S- 0 0 110 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.264 123.0-102.7 -99.2 10.0 17.4 51.0 18.5 131 134 A G T < 5 + 0 0 65 -3,-1.8 -3,-0.2 1,-0.3 2,-0.2 0.628 69.4 148.2 85.8 11.4 21.1 51.3 18.8 132 135 A V < 0 0 19 -5,-2.3 -1,-0.3 1,-0.1 -2,-0.1 -0.519 360.0 360.0 -78.3 149.6 22.1 47.7 19.0 133 136 A S 0 0 92 -2,-0.2 -118,-2.5 -120,-0.1 -117,-0.1 0.348 360.0 360.0-131.9 360.0 25.4 46.6 17.5 134 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 135 4 B D 0 0 130 0, 0.0 2,-0.4 0, 0.0 31,-0.2 0.000 360.0 360.0 360.0 -49.6 22.1 12.0 43.3 136 5 B V - 0 0 45 1,-0.1 3,-0.1 29,-0.1 23,-0.1 -0.999 360.0-173.7-127.5 134.3 19.2 9.5 42.6 137 6 B L S S+ 0 0 68 -2,-0.4 2,-0.4 1,-0.3 -1,-0.1 0.835 79.1 30.8 -89.0 -39.8 15.5 10.4 43.1 138 7 B V - 0 0 15 20,-0.2 2,-0.5 21,-0.0 -1,-0.3 -0.983 67.7-160.2-125.2 124.9 14.1 6.9 42.4 139 8 B K - 0 0 158 -2,-0.4 -3,-0.0 -3,-0.1 19,-0.0 -0.904 27.8-114.8-102.9 134.2 15.9 3.6 43.2 140 9 B W + 0 0 76 -2,-0.5 2,-0.3 15,-0.1 -1,-0.0 -0.234 42.6 167.8 -59.6 148.6 14.7 0.5 41.4 141 10 B S > - 0 0 48 1,-0.0 3,-2.4 0, 0.0 4,-0.2 -0.976 52.4 -98.7-155.3 164.4 13.2 -2.2 43.5 142 11 B E G > S+ 0 0 151 -2,-0.3 3,-1.5 1,-0.3 -2,-0.0 0.725 113.8 76.7 -55.0 -23.4 11.2 -5.5 43.2 143 12 B D G 3 S+ 0 0 112 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.781 99.9 42.5 -57.9 -26.1 8.1 -3.4 43.9 144 13 B L G < S+ 0 0 7 -3,-2.4 -1,-0.3 2,-0.0 -2,-0.2 0.390 90.7 121.8 -99.9 0.9 8.4 -2.2 40.3 145 14 B A < + 0 0 7 -3,-1.5 2,-0.2 -4,-0.2 -3,-0.0 -0.332 22.5 140.9 -75.7 145.9 9.2 -5.6 38.8 146 15 B N - 0 0 5 1,-0.4 -1,-0.1 -2,-0.1 109,-0.1 -0.458 62.4 -11.3-147.7-143.2 7.1 -7.1 36.0 147 16 B L S > S- 0 0 0 -2,-0.2 4,-2.6 120,-0.1 -1,-0.4 -0.402 71.6-114.8 -59.3 149.1 8.0 -9.1 32.9 148 17 B P H > S+ 0 0 75 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.902 116.0 48.8 -57.9 -42.9 11.8 -9.0 32.2 149 18 B S H > S+ 0 0 22 1,-0.2 4,-0.9 2,-0.2 -2,-0.0 0.883 112.4 49.2 -63.5 -35.7 11.3 -7.1 28.9 150 19 B I H >> S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 3,-0.5 0.890 103.5 60.2 -70.2 -39.5 9.0 -4.6 30.6 151 20 B D H 3X S+ 0 0 28 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.880 99.2 58.1 -53.6 -40.5 11.5 -4.1 33.5 152 21 B T H 3X S+ 0 0 78 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.886 111.1 42.0 -58.3 -40.9 14.0 -2.9 30.8 153 22 B Q H S+ 0 0 5 -4,-2.0 5,-2.6 2,-0.2 -1,-0.2 0.924 111.7 46.5 -62.8 -40.5 19.7 18.4 35.7 168 37 B A H ><5S+ 0 0 3 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.913 110.7 51.7 -65.9 -44.7 17.5 20.2 38.1 169 38 B R H 3<5S+ 0 0 160 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.837 110.8 48.7 -59.1 -36.1 20.0 19.8 41.0 170 39 B R T 3<5S- 0 0 191 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.445 111.0-126.8 -83.5 -2.1 22.7 21.3 38.6 171 40 B R T < 5 + 0 0 141 -3,-1.4 2,-0.9 -4,-0.2 -3,-0.2 0.842 58.4 149.1 57.6 39.3 20.2 24.1 37.8 172 41 B D >< + 0 0 76 -5,-2.6 4,-2.6 1,-0.2 -1,-0.2 -0.813 21.0 177.2-107.0 88.2 20.7 23.4 34.1 173 42 B M H > S+ 0 0 28 -2,-0.9 4,-2.4 2,-0.2 5,-0.2 0.837 78.1 55.5 -65.8 -33.7 17.4 24.3 32.5 174 43 B D H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.949 112.1 43.5 -61.0 -46.6 18.4 23.6 29.0 175 44 B K H > S+ 0 0 89 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.915 111.6 55.4 -65.4 -41.4 19.4 20.0 30.0 176 45 B A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.909 109.1 46.2 -58.0 -45.0 16.2 19.7 32.0 177 46 B R H X S+ 0 0 79 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.912 113.8 49.6 -64.6 -39.6 14.1 20.6 29.0 178 47 B E H X S+ 0 0 68 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.951 114.0 43.8 -64.0 -47.1 16.1 18.2 26.8 179 48 B V H X S+ 0 0 10 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.885 111.7 53.8 -67.6 -40.9 15.8 15.3 29.3 180 49 B F H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.3 5,-0.2 0.941 109.9 48.1 -58.5 -45.0 12.1 16.0 29.9 181 50 B D H X S+ 0 0 26 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.934 112.8 47.8 -62.0 -40.5 11.4 15.8 26.1 182 51 B A H X S+ 0 0 30 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.886 111.1 51.7 -69.0 -37.5 13.4 12.6 25.8 183 52 B L H X S+ 0 0 7 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.930 111.4 47.3 -62.7 -46.9 11.5 11.1 28.9 184 53 B K H X S+ 0 0 25 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.940 112.1 49.1 -59.2 -47.4 8.2 12.0 27.3 185 54 B N H X S+ 0 0 72 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.928 112.9 47.7 -63.2 -39.3 9.2 10.5 23.9 186 55 B Y H X S+ 0 0 34 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.922 108.5 54.3 -69.7 -39.5 10.4 7.3 25.6 187 56 B A H X S+ 0 0 7 -4,-2.8 4,-3.2 1,-0.2 5,-0.2 0.915 106.0 52.7 -60.0 -43.5 7.2 7.0 27.6 188 57 B V H X S+ 0 0 67 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.897 111.7 46.2 -56.3 -42.2 5.1 7.2 24.5 189 58 B E H X S+ 0 0 139 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.903 113.0 48.8 -72.3 -36.7 7.2 4.4 23.0 190 59 B H H X S+ 0 0 2 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.940 111.3 49.6 -64.8 -46.6 7.0 2.2 26.2 191 60 B F H X S+ 0 0 7 -4,-3.2 4,-2.5 -5,-0.2 -1,-0.2 0.906 110.6 51.8 -56.3 -41.9 3.2 2.8 26.3 192 61 B G H X S+ 0 0 34 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.901 107.4 52.2 -63.4 -36.5 3.1 1.7 22.6 193 62 B Y H X S+ 0 0 98 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.936 110.9 46.5 -65.5 -49.8 5.0 -1.4 23.4 194 63 B E H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.933 111.4 52.4 -54.5 -45.8 2.6 -2.4 26.2 195 64 B E H X S+ 0 0 39 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.859 107.1 52.2 -63.3 -33.4 -0.4 -1.6 23.9 196 65 B R H X S+ 0 0 159 -4,-2.3 4,-3.2 2,-0.2 -1,-0.2 0.910 109.4 48.7 -69.8 -37.8 1.0 -3.8 21.2 197 66 B L H X S+ 0 0 16 -4,-2.0 4,-2.4 1,-0.2 6,-0.3 0.898 110.8 52.6 -63.5 -39.7 1.4 -6.7 23.7 198 67 B F H <>S+ 0 0 3 -4,-2.4 5,-2.4 -5,-0.2 4,-0.4 0.913 114.8 40.7 -65.9 -39.9 -2.2 -6.0 24.8 199 68 B A H ><5S+ 0 0 67 -4,-2.3 3,-1.4 3,-0.2 -2,-0.2 0.969 115.3 49.6 -67.4 -55.5 -3.4 -6.2 21.2 200 69 B D H 3<5S+ 0 0 93 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.875 120.5 37.0 -51.6 -40.9 -1.2 -9.2 20.2 201 70 B Y T 3<5S- 0 0 86 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.364 106.8-121.4-102.1 9.3 -2.4 -11.2 23.3 202 71 B A T < 5 - 0 0 75 -3,-1.4 -3,-0.2 -4,-0.4 -4,-0.1 0.836 35.9-165.6 57.6 42.0 -6.0 -10.0 23.3 203 72 B Y > < - 0 0 20 -5,-2.4 3,-1.8 -6,-0.3 4,-0.2 -0.348 16.9-139.8 -63.8 124.2 -5.7 -8.5 26.8 204 73 B P T 3 S+ 0 0 95 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.764 98.8 48.6 -61.5 -27.0 -9.2 -7.8 28.2 205 74 B E T 3> S+ 0 0 84 1,-0.2 4,-2.3 2,-0.1 5,-0.2 0.075 74.5 116.3 -98.6 25.6 -8.3 -4.5 29.8 206 75 B A H <> S+ 0 0 27 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.901 73.6 51.7 -58.9 -45.1 -6.5 -3.1 26.7 207 76 B T H > S+ 0 0 121 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.930 112.8 43.9 -58.8 -53.6 -9.0 -0.2 26.2 208 77 B R H > S+ 0 0 174 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.908 114.9 47.6 -59.4 -47.3 -8.8 1.0 29.8 209 78 B H H X S+ 0 0 4 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.928 110.8 51.5 -67.3 -40.8 -5.1 0.8 30.1 210 79 B K H X S+ 0 0 109 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.901 109.5 50.8 -58.8 -40.6 -4.6 2.6 26.7 211 80 B E H X S+ 0 0 61 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.903 107.3 53.6 -68.0 -37.7 -6.8 5.4 27.9 212 81 B I H X S+ 0 0 49 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.924 111.7 45.5 -58.8 -46.8 -4.8 5.7 31.1 213 82 B H H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.918 111.5 52.1 -61.2 -48.5 -1.6 6.0 29.1 214 83 B R H X S+ 0 0 110 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.914 108.4 50.5 -59.8 -43.4 -3.2 8.5 26.7 215 84 B R H X S+ 0 0 148 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.896 110.2 50.5 -62.2 -35.3 -4.4 10.8 29.5 216 85 B F H X S+ 0 0 11 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.905 107.3 52.7 -72.9 -38.3 -0.9 10.8 31.0 217 86 B V H X S+ 0 0 34 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.954 109.9 49.6 -58.4 -44.3 0.7 11.7 27.7 218 87 B E H X S+ 0 0 112 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.917 111.8 49.1 -58.3 -43.6 -1.7 14.6 27.6 219 88 B T H X S+ 0 0 46 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.897 108.9 51.8 -62.9 -41.7 -0.7 15.6 31.2 220 89 B V H X S+ 0 0 4 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.890 107.6 52.5 -64.0 -40.6 3.0 15.4 30.4 221 90 B L H X S+ 0 0 68 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.894 110.5 49.2 -60.5 -39.4 2.5 17.7 27.4 222 91 B K H >X S+ 0 0 125 -4,-1.8 3,-0.7 -5,-0.2 4,-0.7 0.959 111.4 47.9 -64.2 -49.2 0.7 20.2 29.7 223 92 B W H >X S+ 0 0 60 -4,-2.8 3,-1.0 1,-0.2 4,-0.5 0.853 103.4 63.1 -58.5 -35.5 3.5 20.0 32.3 224 93 B E H >< S+ 0 0 44 -4,-2.2 3,-1.5 1,-0.3 4,-0.5 0.852 92.1 64.9 -61.7 -35.9 6.1 20.5 29.6 225 94 B K H X< S+ 0 0 143 -4,-1.1 3,-1.0 -3,-0.7 4,-0.4 0.843 94.6 58.8 -56.8 -35.2 4.7 23.9 28.8 226 95 B Q H > - 0 0 76 -59,-0.0 4,-1.9 -58,-0.0 3,-0.6 -0.543 44.2 -79.9-109.6-175.2 13.2 27.3 36.9 232 101 B P H 3> S+ 0 0 9 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.863 129.5 57.8 -59.4 -31.4 14.8 24.3 38.7 233 102 B E H 3> S+ 0 0 94 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.887 103.7 52.2 -64.7 -36.7 12.1 24.4 41.4 234 103 B V H <> S+ 0 0 40 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.916 107.9 53.0 -61.9 -39.9 9.4 24.0 38.7 235 104 B V H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.926 108.4 50.3 -60.8 -43.8 11.4 21.0 37.4 236 105 B M H X S+ 0 0 54 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.903 109.5 48.9 -62.1 -42.5 11.3 19.6 41.0 237 106 B T H X S+ 0 0 75 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.932 111.8 50.3 -59.8 -45.9 7.5 20.0 41.2 238 107 B T H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.918 108.0 53.8 -58.0 -45.3 7.2 18.3 37.8 239 108 B L H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.883 103.7 55.2 -57.2 -44.1 9.4 15.4 39.0 240 109 B R H X S+ 0 0 150 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.927 111.4 45.1 -55.4 -42.2 7.2 14.9 42.1 241 110 B G H X S+ 0 0 21 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.911 113.7 49.1 -69.3 -42.3 4.2 14.5 39.7 242 111 B L H X S+ 0 0 5 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.941 113.8 44.9 -61.4 -47.6 6.1 12.3 37.3 243 112 B V H X S+ 0 0 23 -4,-3.1 4,-2.7 1,-0.2 5,-0.4 0.904 112.4 51.9 -66.2 -43.4 7.4 9.9 40.0 244 113 B D H X S+ 0 0 114 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.934 114.5 42.6 -59.8 -43.7 4.0 9.8 41.8 245 114 B W H X S+ 0 0 57 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.937 116.0 47.5 -69.0 -48.4 2.2 8.8 38.5 246 115 B L H X S+ 0 0 14 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.917 112.2 47.0 -61.1 -48.7 4.8 6.3 37.3 247 116 B V H X S+ 0 0 41 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.938 116.9 44.6 -62.6 -45.7 5.2 4.4 40.6 248 117 B N H X>S+ 0 0 89 -4,-1.8 4,-3.0 -5,-0.4 5,-0.6 0.932 113.7 50.2 -62.2 -44.6 1.5 4.1 41.0 249 118 B H H X>S+ 0 0 2 -4,-2.8 5,-2.8 2,-0.2 4,-2.0 0.929 113.1 45.5 -62.4 -44.3 0.9 3.2 37.4 250 119 B I H <>S+ 0 0 4 -4,-2.7 5,-1.2 3,-0.2 -1,-0.2 0.943 120.3 39.1 -61.9 -48.0 3.6 0.5 37.5 251 120 B M H <5S+ 0 0 71 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.832 128.8 28.4 -77.1 -32.1 2.5 -1.0 40.7 252 121 B K H <5S+ 0 0 112 -4,-3.0 4,-0.2 -5,-0.2 -3,-0.2 0.830 133.1 20.9 -98.3 -39.5 -1.3 -0.7 40.3 253 122 B E T ><>> S+ 0 0 0 -3,-1.4 4,-2.4 -4,-0.5 -1,-0.2 0.551 91.4 87.4 -90.9 -8.2 -1.3 -7.6 33.0 258 127 B E H S+ 0 0 41 -4,-0.4 4,-0.6 1,-0.2 -1,-0.2 0.919 113.3 39.7 -52.7 -47.6 -2.0 -12.8 32.0 261 130 B L H ><>S+ 0 0 0 -4,-2.4 5,-2.2 2,-0.2 3,-0.8 0.910 112.1 55.2 -76.5 -36.5 1.0 -12.3 29.8 262 131 B R H ><5S+ 0 0 125 -4,-2.9 3,-2.0 1,-0.2 -2,-0.2 0.920 105.3 53.3 -58.1 -43.5 3.3 -14.7 31.7 263 132 B E H 3<5S+ 0 0 144 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.707 106.9 54.5 -70.4 -16.0 0.8 -17.5 31.3 264 133 B R T <<5S- 0 0 108 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.245 123.1-103.1 -98.4 9.2 0.8 -16.8 27.5 265 134 B G T < 5S+ 0 0 66 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.613 70.0 147.0 87.2 9.6 4.6 -17.2 27.2 266 135 B V < 0 0 19 -5,-2.2 -1,-0.3 -69,-0.0 -2,-0.1 -0.514 360.0 360.0 -75.4 148.8 5.5 -13.5 27.0 267 136 B S 0 0 92 -2,-0.2 -120,-0.1 -120,-0.1 -1,-0.0 -0.762 360.0 360.0-135.3 360.0 8.8 -12.4 28.5